Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | HMOX1 | P09601 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27956539 | 0.85 | CYP19A1 (0.55) | CYP19A1PTGS2HMOX1CYP11B1CYP11B2 | |
| SCHEMBL27956578 | 0.82 | CYP19A1 (0.51) | CYP19A1ADRA2CCYP11B1CYP11B2 | |
| SCHEMBL28548797 | 0.82 | CYP19A1 (0.62) | IDO1CYP19A1HMOX1ADRA2C | |
| SCHEMBL29669989 | 0.82 | CYP19A1 (0.62) | IDO1CYP19A1HMOX1ADRA2C | |
| SCHEMBL27709548 | 0.80 | POLB (0.54) | CYP19A1ROCK2 | |
| SCHEMBL28811703 | 0.80 | IDO1 (0.49) | IDO1CYP19A1PTGS2HMOX1ADRA2C | |
| SCHEMBL27956563 | 0.79 | HMOX1 (0.62) | CYP19A1HMOX1CYP11B1CYP11B2 | |
| SCHEMBL27775794 | 0.77 | HMOX2 (0.44) | — | |
| SCHEMBL27956580 | 0.77 | CYP26A1 (0.55) | CYP19A1HMOX1CYP11B1CYP11B2 | |
| SCHEMBL27956566 | 0.77 | CYP19A1 (0.49) | CYP19A1HMOX1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103724271-A | Substituted imidazole-1-ethylene compound and application thereof | LUWAN BRANCH RUI JIN HOSPITAL SHANGHAI JIAO TONG UNIVERSITY SCHOOL OF MEDICINE | 2014-04-16 | — | — | CN | disclosed |